Predicted GC-MS Spectrum - Rubrofusarin 6-gentiobioside GC-MS (TMS_1_4) - 70eV, Positive (HMDB0038478)
Spectrum Details
| HMDB ID: | HMDB0038478 |
|---|---|
| Compound Name: | Rubrofusarin 6-gentiobioside |
| Derivative IUPAC Name: | Not Available |
| Derivative SMILES: | COC1=CC(OC2OC(COC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(O)C(O)C2O)=C2C(O)=C3C(=O)C=C(C)OC3=CC2=C1 |
| Derivative InChIKey: | Not Available |
| Spectrum Type: | Predicted GC-MS Spectrum - Rubrofusarin 6-gentiobioside GC-MS (TMS_1_4) - 70eV, Positive |
| Splash Key: | Not Available |
| Notes: | This is a predicted spectrum, and it should only be used as a guide. Further evidence is required to confirm identification. |
Spectrum View
Experimental Conditions
| Ionization Mode: | Positive |
|---|---|
| Ionization Energy: | 70 eV |
| Chromatography Type: | Gas Chromatography Column (GC) |
| Instrument Type: | Single quadrupole, spectrum predicted by CFM-ID(EI) |
| Mass Resolution: | 0.0001 Da |
| Molecular Formula: | C27H32O15 |
| Molecular Weight (Monoisotopic Mass): | 596.1741 Da |
| Derivative Type: | TMS_1_4 |
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: COC1=CC(OC2OC(COC3OC(CO)C(O)C(O)C3O[Si](C)(C)C)C(O)C(O)C2O)=C2C(O)=C3C(=O)C=C(C)OC3=CC2=C1)
Documentation
| Document Description | Download | File Size |
|---|---|---|
| List of m/z values for the spectrum (TXT) | Download file | 757 Bytes |
| mzML formatted file (MZML) | Download file | 4.66 KB |
References
Not Available